(2S)-2-amino-3-(4-methylphenyl)propanoic acid
TL;DR: (2S)-2-amino-3-(4-methylphenyl)propanoic acid (CAS 4599-47-7) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-(4-methylphenyl)propanoic acid
Also Known As: 4-Methyl-L-phenylalanine, H-Phe(4-Me)-OH, 4-Methylphenylalanine, L-4-Methylphenylalanine, 4-Methylphenyl-L-alanine
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 4599-47-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C[C@@H](C(=O)O)N |
| InChIKey | DQLHSFUMICQIMB-VIFPVBQESA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2S)-2-amino-3-(4-methylphenyl)propanoic acid (CAS 4599-47-7), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: (2S)-2-amino-3-(4-methylphenyl)propanoic acid.
Chemical Property Profile of (2S)-2-amino-3-(4-methylphenyl)propanoic acid
Property Insights of (2S)-2-amino-3-(4-methylphenyl)propanoic acid
The XLogP value of -1.2 indicates that (2S)-2-amino-3-(4-methylphenyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-amino-3-(4-methylphenyl)propanoic acid. Following Lipinski's Rule of Five, (2S)-2-amino-3-(4-methylphenyl)propanoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2S)-2-amino-3-(4-methylphenyl)propanoic acid?
The CAS number of (2S)-2-amino-3-(4-methylphenyl)propanoic acid is 4599-47-7.
What is the molecular formula of (2S)-2-amino-3-(4-methylphenyl)propanoic acid?
The molecular formula of (2S)-2-amino-3-(4-methylphenyl)propanoic acid is C10H13NO2.
What is the molecular weight of (2S)-2-amino-3-(4-methylphenyl)propanoic acid?
The molecular weight of (2S)-2-amino-3-(4-methylphenyl)propanoic acid is 179.09 g/mol.
Where can I buy (2S)-2-amino-3-(4-methylphenyl)propanoic acid?
You can request a quote for (2S)-2-amino-3-(4-methylphenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-amino-3-(4-methylphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-amino-3-(4-methylphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.